UCSF

ZINC39917575

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 32 Yes

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Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.70 14.09 -45.63 1 5 1 35 433.62 11
Hi High (pH 8-9.5) 4.70 11.72 -11.86 0 5 0 34 432.612 11
Mid Mid (pH 6-8) 4.70 13.97 -48.82 1 5 1 35 433.62 11
Lo Low (pH 4.5-6) 4.70 14.38 -80.05 2 5 2 36 434.628 11

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Analogs ( Draw Identity 99% 90% 80% 70% )